[Pw_forum] davidson without overlap

Virginie Quequet virginie.quequet at polytechnique.fr
Thu Apr 28 15:40:57 CEST 2005


Dear PWSCF users,

In previous version of PWSCF (1.2.0), it was possible to choose 
diagonalization = david_nooverlap. I wonder why it is no longer possible, 
do this method cause particular problem?

Best wishes

Virginie Quequet




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